# generated using pymatgen
data_AlNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.46504781
_cell_length_b   3.46504781
_cell_length_c   50.56098535
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNi3
_chemical_formula_sum   'Al6 Ni18'
_cell_volume   607.063318342
_cell_formula_units_Z   6
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Al  Al1  1  1.008727  0.008727  0.291538  1
  Al  Al2  1  1.008727  0.008727  0.361987  1
  Al  Al3  1  1.008727  0.008727  0.434084  1
  Al  Al4  1  0.008727  0.008727  0.506165  1
  Al  Al5  1  0.008727  0.008727  0.578362  1
  Al  Al6  1  0.008727  0.008727  0.648760  1
  Ni  Ni7  1  0.508727  0.008727  0.326580  1
  Ni  Ni8  1  0.508727  0.508727  0.295271  1
  Ni  Ni9  1  1.008727  0.508727  0.326580  1
  Ni  Ni10  1  0.508727  0.008727  0.397976  1
  Ni  Ni11  1  0.508727  0.508727  0.362128  1
  Ni  Ni12  1  1.008727  0.508727  0.397976  1
  Ni  Ni13  1  0.508727  0.008727  0.470091  1
  Ni  Ni14  1  0.508727  0.508727  0.433911  1
  Ni  Ni15  1  1.008727  0.508727  0.470091  1
  Ni  Ni16  1  0.508727  0.008727  0.542273  1
  Ni  Ni17  1  0.508727  0.508727  0.506223  1
  Ni  Ni18  1  0.008727  0.508727  0.542273  1
  Ni  Ni19  1  0.508727  0.008727  0.614172  1
  Ni  Ni20  1  0.508727  0.508727  0.578653  1
  Ni  Ni21  1  0.008727  0.508727  0.614172  1
  Ni  Ni22  1  0.508727  0.008727  0.682580  1
  Ni  Ni23  1  0.508727  0.508727  0.649917  1
  Ni  Ni24  1  0.008727  0.508727  0.682580  1
